N-[2-methoxy-4-[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[2-methoxy-4-[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-2-methoxy-phenyl]furan-2-carboxamide CAS Name: N-[2-methoxy-4-[[1-oxo-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[2-methoxy-4-[[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-2-methoxy-phenyl]-2-furamide Formula: C24H22N6O4S MolecularWeight: 490.53428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=NC=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=NC=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C24H22N6O4S/c1-3-12-30-22(16-8-10-25-11-9-16)28-29-24(30)35-15-21(31)26-17-6-7-18(20(14-17)33-2)27-23(32)19-5-4-13-34-19/h3-11,13-14H,1,12,15H2,2H3,(H,26,31)(H,27,32)